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MCULE-9254616417
Compound
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 5 USD | 97 | 14 working days | Get Quote |
| 5 mg | 5 USD | 97 | 14 working days | Get Quote |
| 10 mg | 5 USD | 97 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9254616417.sdf |
| SMILES | MCULE-9254616417.smiles |
| Standard InChI | MCULE-9254616417.inchi |
| InChIKey | MCULE-9254616417.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903059261 | 97 | As is | 25 g |
| P-905486244 | 97 | As is | 10 g |
| P-610959437 | 90 | As is | 2.65309 kg |
| P-489132258 | 97 | As is | in stock |
| P-580709900 | 97 | As is | 136 g |
| P-871218740 | N/A | As is | by resynthesis (? - ? days) |
| P-505594315 | 97 | As is | in stock |
| P-851280223 | 95 | As is | by synthesis |
| P-868608877 | 98 | As is | in stock |
| P-579478863 | 95 | As is | in stock |
| P-905346265 | 98 | As is | 20 g |
| P-862030245 | 98 | As is | 1.43821 kg |
| P-1272588452 | 95 | As is | 200 g |
| P-852466519 | 95 | As is | by synthesis |
| P-584619383 | 95 | As is | in stock |
| P-608277368 | 98 | As is | in stock |
| P-888853239 | N/A | As is | in stock |
| P-617402759 | 98 | As is | in stock |
| P-613814341 | 95 | As is | in stock |
| P-906756562 | 98 | As is | by synthesis |
| P-615638587 | 95 | As is | unavailable |
| P-861273230 | 95 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 260.219 |
| logP | -1.4846 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 104.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.0033 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
